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Journal of Physics. Condensed Matter : an Institute of Physics Journal|September 13, 2023
First-principles studies on the structural, electronic, and optical properties of 2D transition metal dichalcogenide (TMDC) and Janus TMDCs heterobilayersHaris Habib, Wenjing Zhao, Sibgha Mir, et al.Journal of Chemical Theory and Computation|February 12, 2026
From PECs to Spectrum and From Spectrum to PECs: A Morse Protocol for Diatomic X-ray AbsorptionMinrui Wei, Lu Zhang, Junxiang Zuo, et al.Journal of Computational Chemistry|April 2, 2015
Toward assessment of density functionals for vibronic coupling in two-photon absorption: A case study of 4-nitroanilineRobert Zaleśny, Guangjun Tian, Christof Hättig, et al.Sensors (Basel, Switzerland)|July 17, 2020
Estimation for Runway Friction Coefficient Based on Multi-Sensor Information Fusion and Model CorrelationYadong Niu, Sixiang Zhang, Guangjun Tian, et al.The Journal of Physical Chemistry Letters|September 14, 2021
Electric Field Controlled Single-Molecule Optical Switch by Through-Space Charge Transfer StateGuangjun Tian, Feifei Qiu, Ce Song, et al.The Journal of Physical Chemistry. B|February 4, 2016
First-Principles Simulations of One- and Two-Photon Absorption Band Shapes of the Bis(BF2) Core ComplexRobert Zaleśny, N Arul Murugan, Guangjun Tian, et al.Physical Chemistry Chemical Physics : PCCP|August 15, 2015
The effect of Duschinsky rotation on charge transport properties of molecular junctions in the sequential tunneling regimeGuangjun Tian, Sai Duan, Guang-Ping Zhang, et al.Nanoscale|June 14, 2018
Theoretical modeling of tip-enhanced resonance Raman images of switchable azobenzene molecules on Au(111)Zhen Xie, Sai Duan, Guangjun Tian, et al.The Journal of Chemical Physics|September 6, 2020
Harvesting of surface plasmon polaritons: Role of the confinement factorZu-Yong Gong, Zhen Xie, Guangjun Tian, et al.Physical Chemistry Chemical Physics : PCCP|February 6, 2026
Charge transport properties of tubular boron cluster-based molecular junctions: a first-principles studyJin Wang, Boxuan Xie, Xue Wu, et al.Pageof 6